3555-0267 Screening compound: (1Z)-N-(3,5-dichlorophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-imine

3555-0267 Screening compound: (1Z)-N-(3,5-dichlorophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-imine
3555-0267 Screening compound: (1Z)-N-(3,5-dichlorophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3555-0267
(1Z)-N-(3,5-dichlorophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-imine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

3555-0267

Molecular Formula

C17H16Cl2N2 (C17 H16 Cl2 N2)

Compound Name

(1Z)-N-(3,5-dichlorophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-imine

IUPAC name

(1Z)-N-(35-dichlorophenyl)-33-dimethyl-1234-tetrahydroisoquinolin-1-imine

SMILES

CC(C)(Cc1c2cccc1)N/C2=N\c1cc(Cl)cc(Cl)c1

InChI

InChI=1S/C17H16Cl2N2/c1-17(2)10-11-5-3-4-6-15(11)16(21-17)20-14-8-12(18)7-13(19)9-14/h3-9H,10H2,1-2H3,(H,20,21)

InChI Key

QZOITJPBVPNPTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01605679

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.23

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.109

Distribution Coefficient, logD

5.053

Water Solubility, LogSw

-5.36

Polar Surface Area

19.123

Acid Dissociation Constant (pKa)

12.12

Base Dissociation Constant (pKb)

6.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

3555-0267 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 3555-0267 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3555-0267?
Check Price and Availability of 3555-0267, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3555-0267 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3555-0267
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3555-0267
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 3555-0267 available by request